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Compound Detail

CHEMBL493841

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N#Cc1nc(NCc2ccc(Cl)c(Cl)c2)c2c(n1)N(CC(O)CO)CN2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL493841
Phase Preclinical
Structure Type MOL
InChI Key QHJDRQRPKJYCNW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

395.2
MW (Da)
1.81
ALogP
8
HBA
4
HBD
117.3
PSA (Ų)
0.59
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H16Cl2N6O2
MW 395.25
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.87

Literature References

PubMed DOI Target Context # Activities
19447616 10.1016/j.bmcl.2009.04.142 Plasmodium falciparum 4

Data from ChEMBL 36 via Core Engine